[(7-chloranyl-3-oxidanyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-phenylcarbamate

Systemtic Name: [(7-chloranyl-3-oxidanyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-phenylcarbamate Openeye Name: [(7-chloro-3-hydroxy-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-phenylcarbamate CAS Name: N-phenylcarbamic acid [(7-chloro-3-hydroxy-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] ester IUPAC Name: [(7-chloro-3-hydroxy-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-phenylcarbamate Traditional Name: N-phenylcarbamic acid [(7-chloro-3-hydroxy-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] ester Formula: C22H17ClN4O3 MolecularWeight: 420.84838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=NC3=C2C=C(C=C3)Cl)NOC(=O)NC4=CC=CC=C4)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=NC3=C2C=C(C=C3)Cl)NOC(=O)NC4=CC=CC=C4)O

InChI

InChI=1S/C22H17ClN4O3/c23-15-11-12-18-17(13-15)19(14-7-3-1-4-8-14)26-21(28)20(25-18)27-30-22(29)24-16-9-5-2-6-10-16/h1-13,21,28H,(H,24,29)(H,25,27)